Compounds
| ID | Spectrum Quality | Annotated Name |
|---|
COMPOUND NPA006995
PROPERTIES
| NPAID | NPA006995 |
|---|---|
| CLUSTER ID | 398 |
| NODE ID | 358 |
| NAME | Cryptophycin C |
| FORMULA | C35H43ClN2O7 |
| MOLECULAR WEIGHT (Da) | 639.1890 |
| ACCURATE MASS (Da) | 638.2759 |
| ORIGIN ORGANISM TYPE | Bacterium |
| ORIGIN GENUS | Nostoc |
| ORIGIN SPECIES | sp. GSV 224 |
| InChIKey | QLGFKEFRTAOKJU-XVUNPSCXSA-N |
| InChI | InChI=1S/C35H43ClN2O7/c1-22(2)18-31-35(42)44-29(23(3)14-15-25-10-7-6-8-11-25)12-9-13-32(39)38-28(33(40)37-21-24(4)34(41)45-31)20-26-16-17-30(43-5)27(36)19-26/h6-11,13-17,19,22-24,28-29,31H,12,18,20-21H2,1-5H3,(H,37,40)(H,38,39)/b13-9+,15-14+/t23-,24-,28-,29+,31+/m1/s1 |
| SMILES | COC1=C(Cl)C=C(C[C@H]2NC(=O)/C=C/C[C@@H]([C@H](C)/C=C/C3=CC=CC=C3)OC(=O)[C@H](CC(C)C)OC(=O)[C@H](C)CNC2=O)C=C1 |
| SYNONYMS | |
| Cryptophycin 3 | |
ORIGINAL ISOLATION REFERENCE
| CITATION | Subbaraju, Gottumukkala V.; Golakoti, Trimurtulu; Patterson, Gregory M. L.; Moore, Richard E. Three new cryptophycins from Nostoc sp. GSV 224 Journal of Natural Products 1997 60 (3) 302-305. | ||
|---|---|---|---|
| DOI | 10.1021/np960700a | PMID | 9090872 |
REVISIONS
| VERSION | SMILES | CITATION | ||
|---|---|---|---|---|
| Original Isolation | C[C@@H]1CNC(=O)[C@@H](NC(=O)/C=C/C[C@H](OC(=O)[C@@H](OC1=O)CC(C)C)[C@H](C)/C=C/C2=CC=CC=C2)CC3=CC(=C(C=C3)OC)Cl | Subbaraju, Gottumukkala V.; Golakoti, Trimurtulu; Patterson, Gregory M. L.; Moore, Richard E. Three new cryptophycins from Nostoc sp. GSV 224 Journal of Natural Products 1997 60 (3) 302-305. DOI: 10.1021/np960700a PMID: 9090872 | ||
| 2 | COC1=C(Cl)C=C(C[C@H]2NC(=O)/C=C/C[C@@H]([C@H](C)/C=C/C3=CC=CC=C3)OC(=O)[C@H](CC(C)C)OC(=O)[C@H](C)CNC2=O)C=C1 | Barrow, Russell A.; Hemscheidt, Thomas; Liang, Jian; Paik, Seunguk; Moore, Richard E.; Tius, Marcus A. Total Synthesis of Cryptophycins. Revision of the Structures of Cryptophycins A and C. Journal of the American Chemical Society 1995 117 (9) 2479-2490. DOI: 10.1021/ja00114a011 | ||
